N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzamide

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzamide Openeye Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzamide IUPAC Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzamide Traditional Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-(2,6-dimethylmorpholino)sulfonyl-benzamide Formula: C23H27N3O4S2 MolecularWeight: 473.60818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(OC(C4)C)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(OC(C4)C)C

InChI

InChI=1S/C23H27N3O4S2/c1-14-4-9-19-20(11-24)23(31-21(19)10-14)25-22(27)17-5-7-18(8-6-17)32(28,29)26-12-15(2)30-16(3)13-26/h5-8,14-16H,4,9-10,12-13H2,1-3H3,(H,25,27)